In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2011 | 20 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 4.94 | 12.29 | -48.22 | 0 | 4 | -1 | 66 | 285.404 | 14 | ↓ |
Lo Low (pH 4.5-6) | 4.94 | 10.33 | -9.76 | 1 | 4 | 0 | 64 | 286.412 | 14 | ↓ |